methyl 2-[[5-cyclopropyl-1-(5,6-dihydrobenzo[h]quinazolin-2-yl)pyrazol-4-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[5-cyclopropyl-1-(5,6-dihydrobenzo[h]quinazolin-2-yl)pyrazol-4-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[5-cyclopropyl-1-(5,6-dihydrobenzo[h]quinazolin-2-yl)pyrazole-4-carbonyl]amino]acetate CAS Name: 2-[[[5-cyclopropyl-1-(5,6-dihydrobenzo[h]quinazolin-2-yl)-4-pyrazolyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[5-cyclopropyl-1-(5,6-dihydrobenzo[h]quinazolin-2-yl)pyrazole-4-carbonyl]amino]acetate Traditional Name: 2-[[5-cyclopropyl-1-(5,6-dihydrobenzo[h]quinazolin-2-yl)pyrazole-4-carbonyl]amino]acetic acid methyl ester Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=C(N(N=C1)C2=NC=C3CCC4=CC=CC=C4C3=N2)C5CC5

Isomeric SMILES

COC(=O)CNC(=O)C1=C(N(N=C1)C2=NC=C3CCC4=CC=CC=C4C3=N2)C5CC5

InChI

InChI=1S/C22H21N5O3/c1-30-18(28)12-23-21(29)17-11-25-27(20(17)14-7-8-14)22-24-10-15-9-6-13-4-2-3-5-16(13)19(15)26-22/h2-5,10-11,14H,6-9,12H2,1H3,(H,23,29)